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Compound Detail

CHEMBL2220209

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FC(F)(F)c1ccc(Sc2ccccc2N2CCNCC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2220209
Phase Preclinical
Structure Type MOL
InChI Key OMMHQUDWONZRDG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

338.4
MW (Da)
4.27
ALogP
3
HBA
1
HBD
15.3
PSA (Ų)
0.90
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H17F3N2S
MW 338.40
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -1.31

Data from ChEMBL 36 via Core Engine